methyl 3-[2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzoate Openeye Name: methyl 3-[[2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzoate CAS Name: 3-[[2-[[5-chloro-1-(2-methoxyethyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetyl]amino]benzoic acid methyl ester Formula: C20H20ClN3O4S MolecularWeight: 433.9085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C20H20ClN3O4S/c1-27-9-8-24-17-7-6-14(21)11-16(17)23-20(24)29-12-18(25)22-15-5-3-4-13(10-15)19(26)28-2/h3-7,10-11H,8-9,12H2,1-2H3,(H,22,25)